%chk=000128585.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000128585

0 1
 S  -0.3345000       2.990700     -0.3896000    
 S    2.358300      -1.929200     -0.3916000    
 N  -0.8659000      0.3185000     -0.1846000    
 N   -2.352300      -2.027300      0.1004000    
 C  -0.2412000     -0.9094000     -0.1798000    
 C    1.311500      0.6917000     -0.4296000    
 C   7.6600000E-02   1.302300     -0.3369000    
 C    1.111200     -0.7100000     -0.3301000    
 C    2.611200       1.381100     -0.6032000    
 C   -2.243300      0.3868000     -4.6799999E-02
 C   -1.054800      -2.089900     -2.9700000E-02
 C   -2.927400     -0.7646000      8.8500001E-02
 C  -0.2344000       3.426700       1.368200    
 C    2.785100      -2.067500       1.364700    
 H    3.179100       1.359100      0.3328000    
 H    3.210800      0.8955000      -1.380300    
 H    2.497400       2.427800     -0.8998000    
 H   -2.733400       1.351700     -5.0400000E-02
 H  -0.5718000      -3.080200     -2.2900000E-02
 H   -4.006400     -0.7441000      0.1984000    
 H   0.7753000       3.247500       1.747600    
 H  -0.9491000       2.837300       1.948900    
 H  -0.4723000       4.486500       1.491000    
 H    3.574000      -2.814200       1.486600    
 H    1.913100      -2.381200       1.945200    
 H    3.148000      -1.109100       1.746000    


%chk=000128585-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000128585

0 1
S -0.358991 3.042012 -0.401248
S 2.321396 -2.084547 -0.418315
N -0.949482 0.300145 -0.181841
N -2.511875 -2.051807 0.033762
C -0.319697 -0.987296 -0.173841
C 1.302397 0.642390 -0.374890
C 0.040434 1.286902 -0.298706
C 1.076837 -0.768053 -0.294029
C 2.630176 1.331195 -0.519026
C -2.334592 0.396029 -0.094349
C -1.168765 -2.127365 -0.063728
C -3.072557 -0.774131 0.012242
C -0.240958 3.544468 1.433089
C 3.022395 -2.069404 1.345958
H 3.112550 1.492656 0.464967
H 3.319024 0.713842 -1.121916
H 2.511756 2.318763 -0.996463
H -2.763514 1.399328 -0.127966
H -0.714813 -3.123645 -0.059075
H -4.162171 -0.727473 0.082436
H 0.783656 3.374225 1.794332
H -0.965512 2.970221 2.028979
H -0.484958 4.617978 1.469187
H 3.795947 -2.853253 1.374429
H 2.223531 -2.297831 2.066901
H 3.472586 -1.088851 1.562112


